N-(3-imidazol-1-ylpropyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-(3,4,5-trimethoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1-(3,4,5-trimethoxyphenyl)-9H-$b-carboline-3-carboxamide Formula: C27H27N5O4 MolecularWeight: 485.53438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C3C(=CC(=N2)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C3C(=CC(=N2)C(=O)NCCCN4C=CN=C4)C5=CC=CC=C5N3

InChI

InChI=1S/C27H27N5O4/c1-34-22-13-17(14-23(35-2)26(22)36-3)24-25-19(18-7-4-5-8-20(18)30-25)15-21(31-24)27(33)29-9-6-11-32-12-10-28-16-32/h4-5,7-8,10,12-16,30H,6,9,11H2,1-3H3,(H,29,33)